Base information
| Cat. No. | |
| CAS No. | 31212-28-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H5NO5S |
| Molecular Weight | 203.173 |
| Exact Mass | 202.989 |
| XLogP3 | 2.4455 |
| Mr | 45.1228 |
| PSA | 108.57 |
| Sequence | - |
| Atom number | 18 |
| Bond number | 18 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | [O-][N+](=O)c1ccccc1S(=O)(=O)O |
